CID 24708951

2-amino-1-(4-hydroxypiperidin-1-yl)-4-methylpentan-1-one hydrochloride

Structural Information

Molecular Formula
C11H22N2O2
SMILES
CC(C)CC(C(=O)N1CCC(CC1)O)N
InChI
InChI=1S/C11H22N2O2/c1-8(2)7-10(12)11(15)13-5-3-9(14)4-6-13/h8-10,14H,3-7,12H2,1-2H3
InChIKey
ZEBDJUGULIMZPM-UHFFFAOYSA-N
Compound name
2-amino-1-(4-hydroxypiperidin-1-yl)-4-methylpentan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.16812 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.175396 153.6
[M+Na]+ 237.157338 156.2
[M-H]- 213.160844 152.8
[M+NH4]+ 232.201943 169.3
[M+K]+ 253.131278 155.1
[M+H-H2O]+ 197.165380 146.9
[M+HCOO]- 259.166321 168.3
[M+CH3COO]- 273.181971 189.2
[M+Na-2H]- 235.142786 152.0
[M]+ 214.16757142 147.3
[M]- 214.16866858 147.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.